Publications
Found 7 results
Filters: Author is Amrit Jalan [Clear All Filters]
Temperature and Pressure Dependent Kinetics of CH2OO + CH3COCH3 and CH2OO + CH3CHO: Direct Measurements and Theoretical Analysis. International Journal of Chemical Kinetics. 48:474-488.
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2016. Direct Kinetic Measurements of Reactions between the Criegee Intermediate (CH2OO) and Alkenes. Journal of Physical Chemistry A. 118:1997-2006.
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2014. Chemically activated formation of organic acids in reactions of the Criegee intermediate with aldehydes and ketones. Physical Chemistry Chemical Physics. 15:16841-16852.
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2013. An Extensible Framework for Capturing Solvent Effects in Computer Generated Kinetic Models. Journal of Physical Chemistry B. 117:2955-2970.
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2013. New pathways for formation of acids and carbonyl products in low-temperature oxidation: The Korcek decomposition of ?-ketohydroperoxides Journal of the American Chemical Society. 135:11100-11114.
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2013. Which Ab Initio Wave Function Methods Are Adequate for Quantitative Calculations of the Energies of Biradicals? The Performance of Coupled-Cluster and Multi-Reference Methods Along a Single-Bond Dissociation Coordinate Journal of Chemical Theory and Computation. 9:418-431.
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2013. Predicting Solvation Energies for Kinetic Modeling. Annual Reports on the Progress of Chemistry Section C. 106:1-49.
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2010.